S32 | REACH2017 | >68,600 REACH Chemicals
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下载链接：
https://zenodo.org/doi/10.5281/zenodo.6850171
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资源简介：
A 2017 list of REACH chemicals including InChIKeys and spectral information, provided by N. Alygizakis and J. Slobodnik, EI. Dataset DOI: 10.5281/zenodo.2653020.
Update 14 Nov 2019: added CSV. Feb 6th, 2020: edited SMILES in CSV to remove \\ (fixed_SMILES column); edited more SMILES. Nov 6, 2020: fixed entry for (2H5)benzoic acid based on feedback from PubChem. 17 July 2022: more SMILES fixes (CSV only).
提供机构：
Zenodo
创建时间：
2022-07-17
